Match PBE0 Fock Eigenvalue up
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 03-xc.pbe0_fock.inp
Value | Reference | Precision | Status |
-1.024753000000000e+00 | -1.024722000000000e+00 | 3.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)